SCHEMBL6877576

SCHEMBL6877576

Cc1cccc(NC(=O)NC2CCC(Nc3cc(N(C)C)c4ccccc4n3)CC2)c1C

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
TP53 P04637 1/20 0.44
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
MCHR1 Q99705 7/20 0.44
ADRA2A P08913 6/20 0.44
EPHX1 P07099 2/20 0.42
TSHR P16473 1/20 0.41
S1PR1 P21453 1/20 0.40
OPRD1 P41143 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6877566 1.00 RXFP1 (0.45) RXFP1SMN1; SMN2TP53KDM4ELMNA
SCHEMBL6880627 0.93 RXFP1 (0.49) RXFP1SMN1; SMN2TP53KDM4ELMNA
SCHEMBL6880619 0.93 RXFP1 (0.49) RXFP1SMN1; SMN2TP53KDM4ELMNA
SCHEMBL7039512 0.91 SMN1; SMN2 (0.53) SMN1; SMN2KDM4ELMNAMCHR1ADRA2A
SCHEMBL7039508 0.91 SMN1; SMN2 (0.53) SMN1; SMN2KDM4ELMNAMCHR1ADRA2A
SCHEMBL6877624 0.90 GAA (0.51) RXFP1SMN1; SMN2TP53KDM4ELMNA
SCHEMBL6877615 0.90 GAA (0.51) RXFP1SMN1; SMN2TP53KDM4ELMNA
SCHEMBL6877850 0.90 EPHX1 (0.49) RXFP1SMN1; SMN2TP53KDM4ELMNA
SCHEMBL6877843 0.90 EPHX1 (0.49) RXFP1SMN1; SMN2TP53KDM4ELMNA
SCHEMBL6460357 0.90 EPHX1 (0.55) SMN1; SMN2KDM4ELMNAMCHR1ADRA2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1464335-A2 Quinoline, tetrahydroquinoline and pyrimidine derivatives as mch antagonist Taisho Pharmaceutical Co. Ltd. (JP) 2004-10-06 EP disclosed